| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 20 | Yes |
Popular Name: (1S)-1-(4-methoxyphenyl)-2-[(6-methyl-3-pyridyl)methylamino]ethanol (1S)-1-(4-methoxyphenyl)-2-[(6-m…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.18 | 2.63 | -8.43 | 2 | 4 | 0 | 54 | 272.348 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 4.03 | -50.67 | 3 | 4 | 1 | 59 | 273.356 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | 4.47 | -110.78 | 4 | 4 | 2 | 60 | 274.364 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | 3.07 | -32.78 | 3 | 4 | 1 | 56 | 273.356 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
